NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 58 N 4.6263 8.4093 119.2046 53.0168 39.2561 171.5632 59 P 4.4472 0.0000 0.0000 60.6176 32.6373 174.9374 60 A 5.4118 8.5258 123.8251 50.2856 21.3089 177.5761 61 I 3.5511 8.1381 111.9932 61.9330 37.1201 180.6871 62 Q 3.0053 7.8806 118.2313 56.7597 32.0221 176.7224 63 N 4.1804 7.9116 115.6379 56.6217 38.4658 176.9091 64 I 3.6512 9.2373 120.7836 64.5770 37.2630 178.1428 65 R 3.9303 8.0689 118.5176 59.9822 29.8528 177.8578 66 L 3.8029 8.2074 118.0619 58.1508 41.6103 179.5477 67 R 4.1534 8.2459 117.3706 60.0021 30.2606 178.4480 68 H 4.0618 7.8646 116.1001 59.3834 29.8576 176.8849 69 E 3.9452 8.7711 121.3373 59.1662 29.2680 178.4836 70 N 4.2925 9.0474 117.7748 56.1530 38.6843 177.0204 71 K 4.0547 8.1075 121.0011 59.9643 32.3836 178.5178 72 D 4.4938 8.0465 118.7918 57.1169 40.4073 178.8746 73 L 3.9980 7.7305 119.0054 57.3530 42.0063 178.6435 74 K 3.9132 8.9739 120.5890 59.6923 32.1472 178.0169 75 A 4.1650 8.3052 122.2575 54.7263 18.2409 179.5148 76 R 3.8848 7.7565 115.5544 59.6224 30.0733 178.6965 77 L 4.3341 7.6647 114.8958 56.2223 41.6933 178.5872 78 E 4.1432 8.1075 120.3620 58.8625 29.3285 178.5009 79 N 4.5153 8.2504 115.0134 55.4463 37.9162 177.7105 80 A 4.1589 7.9421 121.6927 52.0080 18.0216 178.9225 *82 E 4.2330 8.2997 119.6692 57.9839 31.8216 178.3052 83 V 3.6208 8.9500 119.6918 65.7604 31.4999 177.6445 84 A 4.1287 8.2888 120.9136 55.3270 18.2527 179.7401 85 G 3.6666 8.0287 103.3959 48.0830 0.0000 175.6373 86 R 3.9903 9.0540 122.4030 59.8570 30.1437 177.9573 87 D 4.4879 9.0157 119.1378 55.6470 40.6416 179.0123 88 F 3.7264 9.3692 121.9097 61.2477 40.0900 178.2078 89 K 4.0633 8.3585 118.5677 59.5007 32.4728 178.7602 90 R 3.8665 7.6780 120.2634 59.0221 29.8462 177.7474 91 A 3.8878 8.2617 118.9738 55.6244 18.6182 178.5576 92 E 3.6357 8.5982 116.1948 59.4404 29.6290 179.0246 93 E 3.8303 9.0532 118.9318 59.4034 29.9622 179.2147 94 L 3.9175 7.6311 119.0146 58.1587 41.9805 179.3739 95 E 3.9226 8.1584 116.9214 59.1697 28.9514 179.3321 96 K 4.1048 8.0145 119.0479 58.8862 32.6042 178.6046 97 A 3.9442 7.9195 119.4204 53.5968 18.1628 178.8071 98 K 4.0587 8.0878 117.6768 59.0314 33.4356 178.1454 99 Q 3.9396 7.6317 119.2869 59.3035 28.7114 178.2433 100 A 3.8962 8.9285 121.7424 55.9352 18.0421 179.4026 101 L 3.9249 7.9882 118.0359 57.8854 42.1219 179.2699 102 E 3.9787 8.8807 118.4628 59.2572 29.3737 178.6261 103 D 4.3486 8.2645 120.1458 57.6583 41.0460 178.7700 104 Q 4.0185 7.8236 118.4824 59.2400 28.7518 179.6693 105 R 4.0294 7.6541 116.3309 58.8179 29.6448 178.8307 106 K 3.9402 8.4401 120.7402 59.4551 32.1723 177.9484 107 D 4.2841 8.4410 118.1219 58.0360 41.0686 178.9047 108 L 3.9853 8.0746 118.6250 57.4887 41.6112 179.0225 109 E 3.9500 8.1221 119.5945 59.6544 28.9680 179.2017 110 T 3.8522 7.7153 109.2029 64.8801 68.7548 176.5506 111 K 4.2042 8.1240 121.5744 59.0001 31.9104 179.3183 112 L 3.9982 8.7336 120.0835 57.6953 41.6135 178.9462 113 K 3.7122 8.2098 119.7249 59.9298 31.7670 178.0539 114 E 4.3035 9.3677 120.2628 58.9993 29.2622 179.2565 115 L 4.1439 7.7592 119.5929 57.5730 42.0610 178.0187 116 Q 3.9835 8.7161 120.6640 59.6567 28.7280 178.1637 117 Q 4.0394 8.0752 118.1486 59.9778 28.4597 177.9462 118 D 4.2340 8.1486 116.1012 57.1228 40.6341 178.1744 119 Y 4.2179 7.0305 120.6386 61.5780 39.3934 177.8929 120 D 4.5598 8.4491 117.4644 56.7324 41.4815 176.9154 121 L 4.6102 7.7553 115.3880 54.0022 44.3408 178.4028 122 A 3.8574 8.8229 121.9243 54.9698 18.1141 179.6585 123 K 3.8713 7.9338 116.8061 59.5271 32.0508 178.7347 124 E 3.7956 8.0668 119.0372 60.1400 29.4010 178.2266 125 S 3.6177 8.0399 112.5681 61.4304 62.3055 175.9163 126 T 3.7572 8.9683 118.6430 67.2742 68.5015 175.7973 127 S 4.1104 8.7540 114.7952 61.5855 61.9799 175.7089 128 W 4.6712 8.4922 116.9954 57.4628 28.0892 177.5361 129 D 4.3844 8.3005 121.5806 57.5451 40.5466 178.7594 130 R 3.9390 7.9517 118.4107 59.1075 29.9523 178.7366 131 Q 4.0028 8.2704 118.0504 59.5171 28.6922 178.9376 132 R 3.8869 7.6371 118.0544 59.6096 30.1267 178.4958 133 L 3.9016 8.3320 119.6446 58.9482 41.9176 178.7129 134 E 3.9106 8.8980 118.3858 59.3467 29.4308 178.8941 135 K 3.7632 8.4276 119.3052 60.0171 32.2040 178.0948 136 E 3.8799 8.5197 119.5456 59.5282 29.4119 178.7214 137 L 4.0568 7.8856 118.4066 57.7906 41.2869 179.3512 138 E 3.9933 8.4589 119.5439 59.1347 29.5976 178.3373 139 E 3.9173 8.6611 119.5994 59.2288 29.5763 178.5323 140 K 3.8426 8.5362 119.7330 59.5263 32.1930 178.4501 141 K 4.0801 8.8834 119.8009 59.6176 31.9519 178.7943 142 E 3.8512 7.8893 118.2154 59.2192 29.5614 178.2336 143 A 4.0199 8.3124 121.2953 55.4441 18.2741 179.3518 144 L 3.9132 8.7951 118.1598 58.1309 41.7721 179.4821 145 E 3.9291 8.3830 118.5861 59.4688 29.4850 179.0591 146 L 3.8801 8.6263 120.3647 58.4069 42.1400 178.7736 147 A 4.0291 8.3129 120.7584 55.4483 18.1068 179.7448 148 I 3.6997 8.0221 118.4777 64.3285 36.6767 177.6738 149 D 4.3905 8.5536 119.3500 57.7002 40.9189 178.1855 150 Q 3.9845 8.1839 119.2484 59.2277 28.8298 178.2086 151 A 4.0307 7.7820 120.1522 55.6476 18.6698 179.4842 152 S 4.2525 8.1541 113.4507 62.2071 62.9745 177.4228 153 R 3.7804 7.7074 119.8453 59.4371 30.2567 177.8542 154 D 4.4266 8.4809 119.0220 57.6880 40.7671 177.8380 155 Y 3.9281 8.4610 120.2738 61.4323 38.5229 178.1876 156 H 4.8210 8.2295 117.6749 58.2093 29.2654 177.1680 157 R 3.9777 8.6836 120.8240 59.7991 29.8516 178.0490 158 A 3.9603 8.2435 120.3539 55.6600 18.3165 179.7285 159 T 4.1808 8.0798 107.7150 64.4157 68.6795 176.8290 160 A 3.9268 8.0702 124.0548 55.0601 18.4375 179.0994 161 L 3.9382 7.9706 116.9051 58.6549 41.6439 179.0681 162 E 3.8092 8.5402 117.7508 59.8328 29.3332 179.2677 163 K 3.7775 8.3841 118.7939 59.8985 32.3730 178.0565 164 E 4.2459 8.7655 121.0773 58.9159 29.3719 178.5588 165 L 3.9186 8.1224 118.4460 58.0759 41.4582 178.9918 166 E 3.6871 8.5667 119.1247 59.7753 29.3012 179.2263 167 E 3.9497 8.6014 118.6058 59.1559 29.5956 178.7565 168 K 3.7925 8.0352 119.7474 59.7070 32.0448 178.2815 169 K 3.8145 8.6668 119.3762 59.6096 32.0308 178.7751 170 K 3.8312 7.7722 118.6242 59.5246 32.0565 178.1112 171 A 3.9358 7.9068 120.9408 55.4952 18.1680 179.2326 172 L 3.8975 8.2823 117.2449 58.9295 41.7667 178.6624 173 E 3.7523 8.8664 117.1654 59.3018 29.1565 179.7260 174 L 3.7627 8.0744 117.0910 57.9228 42.2013 178.7682 175 A 3.9709 8.7652 121.1747 54.9684 18.1503 179.7231 176 I 3.5261 8.2315 116.2740 64.5290 37.3976 177.3087 177 D 4.2883 8.7861 119.0706 57.4849 40.9016 177.7851 178 Q 3.9171 8.8020 119.5846 59.6051 29.0117 178.9346 179 A 4.0369 8.5259 121.7610 55.4185 18.3063 179.5495 180 S 3.9604 8.4121 111.6577 61.7314 62.4210 175.9753 181 Q 3.9516 8.2612 122.6269 58.8280 28.3468 177.8411 182 D 4.5188 8.1193 119.3902 55.3120 40.2501 177.6310 183 Y 4.4458 7.6974 121.1224 60.8332 38.2472 177.8077 184 N 4.4090 8.5884 117.0842 56.8744 38.5951 177.3844 185 R 3.9154 7.5961 117.8956 59.0435 30.3386 178.0155 186 A 4.0979 8.8569 121.9665 55.4186 18.4382 179.0750 187 N 4.6631 7.8702 113.3427 54.7961 38.6247 177.2702 188 V 3.8476 7.4085 118.7584 64.2882 31.5840 176.0728 189 L 4.4595 7.9296 118.2473 57.3445 43.4663 177.2325 190 E 4.0628 8.0498 117.1786 57.3494 29.4426 176.2682 191 K 4.3874 7.0766 118.7866 54.7283 33.0747 175.6243 192 E 4.2212 8.5015 126.1045 56.7516 29.4158 174.3056 NUM RES H HA HB HB2 HB3 HD1 HD2 HD21 HD22 HD3 HE HE1 HE2 HE21 HE22 HE3 HG HG1 HG12 HG13 HG2 HG3 HZ 58 N 8.41 4.63 0.00 2.70 2.83 0.00 0.00 6.98 6.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 59 P 0.00 4.45 0.00 2.29 2.04 0.00 3.76 0.00 0.00 3.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.93 2.02 0.00 60 A 8.53 5.41 1.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 61 I 8.14 3.55 1.87 0.00 0.00 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.30 0.79 0.91 0.00 0.00 62 Q 7.88 3.01 0.00 2.23 2.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.36 6.77 0.00 0.00 0.00 0.00 0.00 2.40 2.55 0.00 63 N 7.91 4.18 0.00 3.01 2.89 0.00 0.00 6.92 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 64 I 9.24 3.65 1.87 0.00 0.00 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 1.41 0.90 0.00 0.00 65 R 8.07 3.93 0.00 1.87 2.05 0.00 3.23 0.00 0.00 3.34 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 1.74 0.00 66 L 8.21 3.80 0.00 1.92 1.70 0.92 1.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.90 0.00 0.00 0.00 0.00 0.00 0.00 67 R 8.25 4.15 0.00 1.88 2.03 0.00 3.14 0.00 0.00 3.10 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.96 0.00 68 H 7.86 4.06 0.00 3.29 3.54 0.00 5.78 0.00 0.00 0.00 0.00 6.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 69 E 8.77 3.95 0.00 2.14 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.31 2.35 0.00 70 N 9.05 4.29 0.00 2.85 2.84 0.00 0.00 6.64 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 71 K 8.11 4.05 0.00 1.92 1.91 0.00 1.62 0.00 0.00 1.61 0.00 0.00 2.93 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.41 1.48 7.81 72 D 8.05 4.49 0.00 2.82 2.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 73 L 7.73 4.00 0.00 1.86 1.71 0.97 0.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 0.00 0.00 0.00 0.00 0.00 0.00 74 K 8.97 3.91 0.00 1.79 1.99 0.00 1.66 0.00 0.00 1.70 0.00 0.00 3.18 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.77 1.48 7.81 75 A 8.31 4.16 1.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 76 R 7.76 3.88 0.00 1.99 2.01 0.00 3.28 0.00 0.00 3.24 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.81 1.83 0.00 77 L 7.66 4.33 0.00 1.76 1.70 0.91 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 0.00 0.00 0.00 0.00 0.00 0.00 78 E 8.11 4.14 0.00 2.29 1.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.32 2.35 0.00 79 N 8.25 4.52 0.00 3.03 3.08 0.00 0.00 6.61 7.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 80 A 7.94 4.16 1.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 *82 E 8.30 4.23 0.00 2.19 2.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.53 2.31 0.00 83 V 8.95 3.62 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.10 0.00 0.00 0.98 0.00 0.00 84 A 8.29 4.13 1.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 85 G 8.03 3.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 86 R 9.05 3.99 0.00 1.94 2.05 0.00 3.14 0.00 0.00 3.18 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.82 0.00 87 D 9.02 4.49 0.00 2.95 2.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 88 F 9.37 3.73 0.00 3.28 3.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 89 K 8.36 4.06 0.00 2.11 2.12 0.00 1.44 0.00 0.00 1.62 0.00 0.00 3.03 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.69 1.48 7.81 90 R 7.68 3.87 0.00 1.85 2.20 0.00 3.26 0.00 0.00 3.16 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.84 0.00 91 A 8.26 3.89 1.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 92 E 8.60 3.64 0.00 2.08 1.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.42 2.04 0.00 93 E 9.05 3.83 0.00 2.00 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.31 2.55 0.00 94 L 7.63 3.92 0.00 1.87 1.70 0.90 1.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.95 0.00 0.00 0.00 0.00 0.00 0.00 95 E 8.16 3.92 0.00 2.16 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.35 2.35 0.00 96 K 8.01 4.10 0.00 1.95 1.87 0.00 1.66 0.00 0.00 1.65 0.00 0.00 2.98 0.00 0.00 3.07 0.00 0.00 0.00 0.00 1.41 1.42 7.81 97 A 7.92 3.94 1.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 98 K 8.09 4.06 0.00 1.98 2.04 0.00 1.33 0.00 0.00 1.55 0.00 0.00 2.88 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.44 1.54 7.81 99 Q 7.63 3.94 0.00 2.39 2.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.68 0.00 0.00 0.00 0.00 0.00 2.36 2.44 0.00 100 A 8.93 3.90 1.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 101 L 7.99 3.92 0.00 1.73 1.76 0.91 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 0.00 0.00 0.00 0.00 0.00 0.00 102 E 8.88 3.98 0.00 2.23 2.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.28 2.65 0.00 103 D 8.26 4.35 0.00 2.99 2.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 104 Q 7.82 4.02 0.00 2.14 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.19 6.83 0.00 0.00 0.00 0.00 0.00 2.38 2.58 0.00 105 R 7.65 4.03 0.00 2.09 2.17 0.00 2.81 0.00 0.00 3.08 7.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.91 0.00 106 K 8.44 3.94 0.00 1.83 1.83 0.00 1.67 0.00 0.00 1.57 0.00 0.00 2.87 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.43 1.43 7.81 107 D 8.44 4.28 0.00 2.79 2.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 108 L 8.07 3.99 0.00 1.73 1.69 0.91 0.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 0.00 0.00 0.00 0.00 0.00 0.00 109 E 8.12 3.95 0.00 2.15 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.30 2.33 0.00 110 T 7.72 3.85 4.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.21 0.00 0.00 111 K 8.12 4.20 0.00 1.94 1.91 0.00 1.67 0.00 0.00 1.64 0.00 0.00 3.00 0.00 0.00 3.10 0.00 0.00 0.00 0.00 1.65 1.63 7.81 112 L 8.73 4.00 0.00 1.74 1.68 0.90 -0.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 0.00 0.00 0.00 0.00 0.00 0.00 113 K 8.21 3.71 0.00 1.91 1.99 0.00 1.64 0.00 0.00 1.64 0.00 0.00 2.93 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.45 1.52 7.81 114 E 9.37 4.30 0.00 2.23 1.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.68 2.33 0.00 115 L 7.76 4.14 0.00 1.72 1.73 0.99 0.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 0.00 0.00 0.00 0.00 0.00 0.00 116 Q 8.72 3.98 0.00 2.20 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.30 6.50 0.00 0.00 0.00 0.00 0.00 2.35 2.53 0.00 117 Q 8.08 4.04 0.00 2.23 2.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.48 6.44 0.00 0.00 0.00 0.00 0.00 2.62 2.57 0.00 118 D 8.15 4.23 0.00 2.92 2.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 119 Y 7.03 4.22 0.00 3.07 2.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 120 D 8.45 4.56 0.00 2.91 2.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 121 L 7.76 4.61 0.00 1.65 1.52 0.90 1.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.98 0.00 0.00 0.00 0.00 0.00 0.00 122 A 8.82 3.86 1.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 123 K 7.93 3.87 0.00 1.73 1.76 0.00 1.50 0.00 0.00 1.17 0.00 0.00 2.62 0.00 0.00 2.34 0.00 0.00 0.00 0.00 0.93 1.33 7.81 124 E 8.07 3.80 0.00 1.99 1.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.23 2.35 0.00 125 S 8.04 3.62 0.00 3.69 3.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 126 T 8.97 3.76 4.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.16 0.00 0.00 127 S 8.75 4.11 0.00 3.85 4.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 128 W 8.49 4.67 0.00 3.48 3.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 129 D 8.30 4.38 0.00 3.03 2.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 130 R 7.95 3.94 0.00 1.97 2.00 0.00 3.14 0.00 0.00 3.17 7.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 2.00 0.00 131 Q 8.27 4.00 0.00 2.32 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.32 6.73 0.00 0.00 0.00 0.00 0.00 2.45 2.68 0.00 132 R 7.64 3.89 0.00 1.93 2.01 0.00 3.48 0.00 0.00 3.17 7.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 1.90 0.00 133 L 8.33 3.90 0.00 1.76 1.88 0.93 1.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 0.00 0.00 0.00 0.00 0.00 0.00 134 E 8.90 3.91 0.00 2.28 1.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.34 2.33 0.00 135 K 8.43 3.76 0.00 1.81 1.99 0.00 1.62 0.00 0.00 1.55 0.00 0.00 2.89 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.44 1.47 7.81 136 E 8.52 3.88 0.00 2.18 1.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.32 2.41 0.00 137 L 7.89 4.06 0.00 1.77 1.72 0.95 1.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.83 0.00 0.00 0.00 0.00 0.00 0.00 138 E 8.46 3.99 0.00 2.05 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.30 2.36 0.00 139 E 8.66 3.92 0.00 2.12 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.31 2.32 0.00 140 K 8.54 3.84 0.00 1.81 2.00 0.00 1.71 0.00 0.00 1.65 0.00 0.00 2.95 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.44 1.49 7.81 141 K 8.88 4.08 0.00 1.72 1.86 0.00 1.72 0.00 0.00 1.57 0.00 0.00 3.08 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.47 1.59 7.81 142 E 7.89 3.85 0.00 2.05 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.30 2.32 0.00 143 A 8.31 4.02 1.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 144 L 8.80 3.91 0.00 1.82 1.74 0.92 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 0.00 0.00 0.00 0.00 0.00 0.00 145 E 8.38 3.93 0.00 2.16 2.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.55 2.48 0.00 146 L 8.63 3.88 0.00 1.84 1.82 0.92 1.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 0.00 0.00 0.00 0.00 0.00 0.00 147 A 8.31 4.03 1.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 148 I 8.02 3.70 2.02 0.00 0.00 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 0.80 0.91 0.00 0.00 149 D 8.55 4.39 0.00 2.73 2.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 150 Q 8.18 3.98 0.00 2.23 2.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.52 0.00 0.00 0.00 0.00 0.00 2.37 2.59 0.00 151 A 7.78 4.03 1.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 152 S 8.15 4.25 0.00 3.87 3.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 153 R 7.71 3.78 0.00 2.13 2.11 0.00 3.12 0.00 0.00 3.18 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.75 0.00 154 D 8.48 4.43 0.00 2.99 2.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 155 Y 8.46 3.93 0.00 2.98 2.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 156 H 8.23 4.82 0.00 3.25 3.44 0.00 5.83 0.00 0.00 0.00 0.00 6.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 157 R 8.68 3.98 0.00 2.13 2.04 0.00 3.28 0.00 0.00 3.17 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.83 0.00 158 A 8.24 3.96 1.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 159 T 8.08 4.18 4.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.22 0.00 0.00 160 A 8.07 3.93 1.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 161 L 7.97 3.94 0.00 1.80 1.74 0.91 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 0.00 0.00 0.00 0.00 0.00 0.00 162 E 8.54 3.81 0.00 2.07 1.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.29 2.52 0.00 163 K 8.38 3.78 0.00 1.82 1.96 0.00 1.67 0.00 0.00 1.58 0.00 0.00 2.94 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.44 1.47 7.81 164 E 8.77 4.25 0.00 2.14 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.31 2.24 0.00 165 L 8.12 3.92 0.00 1.71 1.70 0.90 0.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.93 0.00 0.00 0.00 0.00 0.00 0.00 166 E 8.57 3.69 0.00 2.16 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.31 2.43 0.00 167 E 8.60 3.95 0.00 2.15 1.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.33 2.53 0.00 168 K 8.04 3.79 0.00 1.96 2.02 0.00 1.55 0.00 0.00 1.64 0.00 0.00 3.02 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.44 1.55 7.81 169 K 8.67 3.81 0.00 1.97 1.87 0.00 1.88 0.00 0.00 1.56 0.00 0.00 2.92 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.46 1.48 7.81 170 K 7.77 3.83 0.00 1.82 1.93 0.00 1.67 0.00 0.00 1.65 0.00 0.00 2.99 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.44 1.46 7.81 171 A 7.91 3.94 1.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 172 L 8.28 3.90 0.00 1.89 1.74 0.92 0.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 0.00 0.00 0.00 0.00 0.00 0.00 173 E 8.87 3.75 0.00 2.15 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.31 2.42 0.00 174 L 8.07 3.76 0.00 1.96 1.65 0.94 1.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.84 0.00 0.00 0.00 0.00 0.00 0.00 175 A 8.77 3.97 1.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 176 I 8.23 3.53 2.05 0.00 0.00 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.39 0.82 0.88 0.00 0.00 177 D 8.79 4.29 0.00 2.66 2.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 178 Q 8.80 3.92 0.00 2.17 2.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.40 0.00 0.00 0.00 0.00 0.00 2.37 2.47 0.00 179 A 8.53 4.04 1.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 180 S 8.41 3.96 0.00 3.82 4.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 181 Q 8.26 3.95 0.00 2.16 2.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.21 6.41 0.00 0.00 0.00 0.00 0.00 2.38 2.40 0.00 182 D 8.12 4.52 0.00 3.03 2.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 183 Y 7.70 4.45 0.00 3.19 3.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 184 N 8.59 4.41 0.00 2.93 2.93 0.00 0.00 6.76 8.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 185 R 7.60 3.92 0.00 1.82 2.12 0.00 3.28 0.00 0.00 3.24 7.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.66 0.00 186 A 8.86 4.10 1.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 187 N 7.87 4.66 0.00 2.72 2.84 0.00 0.00 6.76 7.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 188 V 7.41 3.85 2.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.79 0.00 0.00 1.01 0.00 0.00 189 L 7.93 4.46 0.00 1.60 1.82 0.91 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 0.00 0.00 0.00 0.00 0.00 0.00 190 E 8.05 4.06 0.00 2.05 1.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.26 2.33 0.00 191 K 7.08 4.39 0.00 1.79 1.69 0.00 1.87 0.00 0.00 1.63 0.00 0.00 2.94 0.00 0.00 2.82 0.00 0.00 0.00 0.00 1.37 1.35 7.81 192 E 8.50 4.22 0.00 2.13 1.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.19 2.35 0.00 * Residues marked with a * may have inaccurate shift predictions.